The predominant Ni-multiorbital nature of infinite-layer neodynium nickelate at stoichiometry and with doping is revealed. We investigate the correlated electronic structure of NdNiO_{2} at lower temperatures and show that first-principles many-body theory may account for Kondo(-lattice) features. Yet, those features are not only based on localized Ni-d_{x^{2}-y^{2}} and a Nd-dominated self-doping band, but they heavily build on the participation of Ni-d_{z^{2}} in a Hund-assisted manner. In a tailored three-orbital study, the half-filled regime of the former in-plane Ni orbital remains surprisingly robust even for substantial hole doping δ. Reconstructions of the interacting Fermi surface designate the superconducting region within the exp...
We theoretically investigate the unconventional superconductivity in the newly discovered infinite-l...
Motivated by the recent observation of superconductivity in strontium-doped NdNiO2, we study the sup...
Superconductivity in infinite-layer nickelates holds exciting analogies with that of cuprates, with ...
The search continues for nickel oxide-based materials with electronic properties similar to cuprate ...
Sr-doped infinite layer nickelate ${\textrm{Nd}_{1-{x}}\textrm{Sr}_{x}\textrm{NiO}_2}$ was recently...
Superconductivity with a remarkably high Tc has recently been found in Sr-doped NdNiO2 thin films. ...
Motivated by the recent experimental discovery of superconductivity in the infinite-layer nickelate ...
The recently discovered nickelate superconductors appear, at first glance, to be even more complicat...
We use a combination of Density Functional Theory and Dynamical Mean Field Theory (DFT+DMFT) to stud...
The discovery of superconductivity in infinite-layer nickelates, with transition temperature ($T_c$)...
Motivated by the recent discovery of superconductivity in infinite-layer (Sr,Nd)NiO2 films with Sr c...
We present a computational study based on density functional plus dynamical mean-field theory calcul...
Using the density-functional-based LDA+U method and linear-response theory, we study the magnetic ex...
We investigate charge distribution in the recently discovered high-Tc superconductors, layered nicke...
Effective models are constructed for a newly discovered superconductor (Nd,Sr)NiO2, which has been c...
We theoretically investigate the unconventional superconductivity in the newly discovered infinite-l...
Motivated by the recent observation of superconductivity in strontium-doped NdNiO2, we study the sup...
Superconductivity in infinite-layer nickelates holds exciting analogies with that of cuprates, with ...
The search continues for nickel oxide-based materials with electronic properties similar to cuprate ...
Sr-doped infinite layer nickelate ${\textrm{Nd}_{1-{x}}\textrm{Sr}_{x}\textrm{NiO}_2}$ was recently...
Superconductivity with a remarkably high Tc has recently been found in Sr-doped NdNiO2 thin films. ...
Motivated by the recent experimental discovery of superconductivity in the infinite-layer nickelate ...
The recently discovered nickelate superconductors appear, at first glance, to be even more complicat...
We use a combination of Density Functional Theory and Dynamical Mean Field Theory (DFT+DMFT) to stud...
The discovery of superconductivity in infinite-layer nickelates, with transition temperature ($T_c$)...
Motivated by the recent discovery of superconductivity in infinite-layer (Sr,Nd)NiO2 films with Sr c...
We present a computational study based on density functional plus dynamical mean-field theory calcul...
Using the density-functional-based LDA+U method and linear-response theory, we study the magnetic ex...
We investigate charge distribution in the recently discovered high-Tc superconductors, layered nicke...
Effective models are constructed for a newly discovered superconductor (Nd,Sr)NiO2, which has been c...
We theoretically investigate the unconventional superconductivity in the newly discovered infinite-l...
Motivated by the recent observation of superconductivity in strontium-doped NdNiO2, we study the sup...
Superconductivity in infinite-layer nickelates holds exciting analogies with that of cuprates, with ...